10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol

C26H25NO3 — CID 22314901

IUPAC10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol
SMILESCOc1c(O)ccc2c1-c1ccc3c(c1C(c1ccccc1)O2)C(C)=CC(C)(C)N3
InChIInChI=1S/C26H25NO3/c1-15-14-26(2,3)27-18-11-10-17-22-20(13-12-19(28)25(22)29-4)30-24(23(17)21(15)18)16-8-6-5-7-9-16/h5-14,24,27-28H,1-4H3
InChIKeyYEHYAJFHTQBDDU-UHFFFAOYSA-N
MW399.49 g/mol
LogP6.16
Rot. Bonds2

About 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol

10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol (PubChem CID 22314901) has the molecular formula C26H25NO3 and a molecular weight of 399.49 g/mol. Its IUPAC name is 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol.

Molecular Properties

Compound Name10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol
PubChem CID22314901
Molecular FormulaC26H25NO3
Molecular Weight399.49 g/mol
Exact Mass399.18
IUPAC Name10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol
SMILESCOc1c(O)ccc2c1-c1ccc3c(c1C(c1ccccc1)O2)C(C)=CC(C)(C)N3
InChIInChI=1S/C26H25NO3/c1-15-14-26(2,3)27-18-11-10-17-22-20(13-12-19(28)25(22)29-4)30-24(23(17)21(15)18)16-8-6-5-7-9-16/h5-14,24,27-28H,1-4H3
InChIKeyYEHYAJFHTQBDDU-UHFFFAOYSA-N
XLogP6.16
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.49
LogP ≤ 56.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol?
The IUPAC name of 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol (CID 22314901) is 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol.
What is the SMILES notation for 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol?
The canonical SMILES for 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol is COc1c(O)ccc2c1-c1ccc3c(c1C(c1ccccc1)O2)C(C)=CC(C)(C)N3.
What is the InChIKey of 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol?
The InChIKey is YEHYAJFHTQBDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25NO3/c1-15-14-26(2,3)27-18-11-10-17-22-20(13-12-19(28)25(22)29-4)30-24(23(17)21(15)18)16-8-6-5-7-9-16/h5-14,24,27-28H,1-4H3.
What are the key properties of 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol?
10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol has a molecular weight of 399.49 g/mol, XLogP of 6.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methoxy-2,2,4-trimethyl-5-phenyl-1,5-dihydrochromeno[3,4-f]quinolin-9-ol is sourced from PubChem (CID 22314901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).